Origin of intrinsic 3 10-helix versus strand stability in homopolypeptides and its implications for the accuracy of the amber force field

Journal of Computational Chemistry

Volumn 28, Issue 10, 2007, Pages 1648-1657

  Jagielska, Anna ^a   Skolnick, Jeffrey ^a  

^a GEORGIA INSTITUTE OF TECHNOLOGY   (United States)

Author keywords

Amber potential; Force field accuracy; Helix versus strand stability; Polypeptides; Quantum mechanical calculations

Indexed keywords

AMBER POTENTIAL; FORCE FIELD ACCURACY; HELIX VERSUS STRAND STABILITY; QUANTUM MECHANICAL CALCULATIONS;

CONFORMATIONS; MOLECULAR MECHANICS; MOLECULAR STRUCTURE; PROTEINS; QUANTUM THEORY;

POLYPEPTIDES;

PEPTIDE;

ALGORITHM; ARTICLE; CHEMISTRY; GAS; HYDROGEN BOND; PHASE TRANSITION; PROTEIN CONFORMATION; QUANTUM THEORY; THERMODYNAMICS;

ALGORITHMS; GASES; HYDROGEN BONDING; PEPTIDES; PHASE TRANSITION; PROTEIN CONFORMATION; QUANTUM THEORY; THERMODYNAMICS;

EID: 34547239960     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.20616     Document Type: Article

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